Vitas-M small molecule compound
2-{[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-6,8-dioxabicyclo[3.2.1]octan-4-one (non-preferred name)
Catalog ID
STK341705
SMILES O=C1CC(Sc2nc(cc(n2)C(F)(F)F)c2cccs2)C2OC1OC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C15H11F3N2O3S2 MW 388.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11F3N2O3S2/c16-15(17,18)12-4-7(10-2-1-3-24-10)19-14(20-12)25-11-5-8(21)13-22-6-9(11)23-13/h1-4,9,11,13H,5-6H2InChIKey
IJLZWHNNJXHORO-UHFFFAOYSA-NSynonyms
1093642-59-1(1R2S5R)2((4(THIOPHEN2YL)6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFANYL)68DIOXABICYCLO(321)OCTAN4ONE(NONPREFERREDNAME)
1093642591
2((4(thiophen2yl)6(trifluoromethyl)pyrimidin2yl)sulfanyl)68dioxabicyclo(321)octan4one(nonpreferredname)
2(4THIOPHEN2YL6(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFANYL68DIOXABICYCLO(321)OCTAN4ONE
4(4(2THIENYL)6(TRIFLUOROMETHYL)PYRIMIDIN2YLTHIO)78DIOXABICYCLO(321)OCTAN2ONE
C1C(C2COC(C1=O)O2)SC3=NC(=CC(=N3)C(F)(F)F)C4=CC=CS4
InChI=1SC15H11F3N2O3S2c1615(1718)1247(102132410)1914(2012)251158(21)132269(11)2313h1491113H56H2
MFCD03034900
ZINC000102998791
ZINC000102998794
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